2-Amino-4-(hydroxymethyl)hex-5-ynoic acid
TL;DR: 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid (CAS 23840-13-3) is a chemical compound with molecular formula C7H11NO3 and molecular weight 157.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(hydroxymethyl)hex-5-ynoic acid
Also Known As: 2-amino-4-(hydroxymethyl)hex-5-ynoic acid, 2-Amino-4-(hydroxymethyl)hex-5-ynoate, 2-Amino-4-hydroxymethyl-5-hexynoic acid, 2-amino-4-hydroxymethylhex-5-ynoic acid, 5-Hexynoic acid, 2-amino-4-(hydroxymethyl)-
| Molecular Formula | C7H11NO3 |
|---|---|
| Molecular Weight | 157.07 g/mol |
| LogP | -3.3 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 157.0739 |
| Heavy Atoms | 11 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 23840-13-3 |
|---|---|
| SMILES | C#CC(CC(C(=O)O)N)CO |
| InChIKey | VLIHXBQWXDIQTE-UHFFFAOYSA-N |
Product Overview
2-Amino-4-(hydroxymethyl)hex-5-ynoic acid (CAS 23840-13-3), with molecular formula C7H11NO3 and molecular weight 157.07 g/mol. IUPAC: 2-amino-4-(hydroxymethyl)hex-5-ynoic acid.
Chemical Property Profile of 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid
Property Insights of 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid
The XLogP value of -3.3 indicates that 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid. Following Lipinski's Rule of Five, 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid?
The CAS number of 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid is 23840-13-3.
What is the molecular formula of 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid?
The molecular formula of 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid is C7H11NO3.
What is the molecular weight of 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid?
The molecular weight of 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid is 157.07 g/mol.
Where can I buy 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid?
You can request a quote for 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-4-(hydroxymethyl)hex-5-ynoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.